Found 4 results

Search term: MF = 'C_{39}H_{61}N_{5}O_{11}'
ChemSpider 2D Image | N-[(1S,2S,3S,6R,8R,9R,10R,13Z,17Z,18R)-13-{[(2-Amino-3-pyridinyl)methoxy]imino}-9-{[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-3-ethyl-2-hydroxy-2,6,8,10,18-pentam ethyl-5,7-dioxo-4,11,15-trioxabicyclo[8.5.4]nonadec-17-ylidene]acetamide | C39H61N5O11

N-[(1S,2S,3S,6R,8R,9R,10R,13Z,17Z,18R)-13-{[(2-Amino-3-pyridinyl)methoxy]imino}-9-{[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-3-ethyl-2-hydroxy-2,6,8,10,18-pentam ethyl-5,7-dioxo-4,11,15-trioxabicyclo[8.5.4]nonadec-17-ylidene]acetamide

  • Molecular FormulaC39H61N5O11
  • Average mass775.929 Da
  • Monoisotopic mass775.436768 Da
  • ChemSpider ID8231558

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 12 of 12 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

N-[(1S,2S,3S,6R,8R,9R,10R,13Z,17Z,18R)-13-{[(2-Amino-3-pyridinyl)methoxy]imino}-9-{[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-3-ethyl-2-hydroxy-2,6,8,10,18-pentam ethyl-5,7-dioxo-4,11,15-trioxabicyclo[8.5.4]nonadec-17-yliden]acetamid [German] [ACD/IUPAC Name]
N-[(1S,2S,3S,6R,8R,9R,10R,13Z,17Z,18R)-13-{[(2-Amino-3-pyridinyl)methoxy]imino}-9-{[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-3-ethyl-2-hydroxy-2,6,8,10,18-pentam ethyl-5,7-dioxo-4,11,15-trioxabicyclo[8.5.4]nonadec-17-ylidene]acetamide [ACD/IUPAC Name]
N-[(1S,2S,3S,6R,8R,9R,10R,13Z,17Z,18R)-13-{[(2-Amino-3-pyridinyl)méthoxy]imino}-9-{[(2S,3R,4S,6R)-4-(diméthylamino)-3-hydroxy-6-méthyltétrahydro-2H-pyran-2-yl]oxy}-3-éthyl-2-hydroxy-2,6,8,10,18-pentam éthyl-5,7-dioxo-4,11,15-trioxabicyclo[8.5.4]nonadéc-17-ylidène]acétamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 919.2±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 140.0±3.0 kJ/mol
Flash Point: 509.7±37.1 °C
Index of Refraction: 1.585
Molar Refractivity: 198.9±0.5 cm3
#H bond acceptors: 16
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 2.43
ACD/LogD (pH 5.5): -0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 9.86
ACD/KOC (pH 7.4): 109.06
Polar Surface Area: 214 Å2
Polarizability: 78.9±0.5 10-24cm3
Surface Tension: 45.3±7.0 dyne/cm
Molar Volume: 593.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement